Chemical Properties of Phenanthridine (CAS 229-87-8)

Phenanthridine

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InChI
InChI=1S/C13H9N/c1-2-6-11-10(5-1)9-14-13-8-4-3-7-12(11)13/h1-9H
InChI Key
RDOWQLZANAYVLL-UHFFFAOYSA-N
Formula
C13H9N
SMILES
c1ccc2c(c1)cnc1ccccc12
Molecular Weight1
179.22
CAS
229-87-8
Other Names
  • 3,4-Benzoisoquinoline
  • 3,4-Benzoquinoline
  • 6-Phenanthridine
  • 9-Azaphenanthrene
  • Benzo[c]quinoline
Sources

Physical Properties

Property Value Unit Source
Δcsolid -6542.80 ± 1.20 kJ/mol NIST
Δfgas 240.50 ± 4.20 kJ/mol NIST
Δfsolid 141.90 ± 1.40 kJ/mol NIST
Δsub 98.60 ± 4.00 kJ/mol NIST
Δsub 98.60 kJ/mol NIST
Δsub 98.60 kJ/mol NIST
IE 8.31 ± 0.02 eV NIST
IE 8.40 ± 0.10 eV NIST
logPoct/wat 3.39 Crippen Calculated Property
solid,1 bar 205.91 J/mol×K NIST
solid,1 bar 205.91 J/mol×K NIST
solid,1 bar 205.87 J/mol×K NIST
Tboil 622.20 K NIST
Tfus [372.65; 379.65] K Show Hide
Tfus 379.40 ± 1.00 K NIST
Tfus 379.65 ± 1.00 K NIST
Tfus 379.65 ± 1.50 K NIST
Tfus 372.65 ± 2.00 K NIST
Tfus 377.00 ± 2.00 K NIST
Ttriple 379.94 ± 0.02 K NIST
Ttriple 379.74 ± 0.02 K NIST

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,solid 201.87 J/mol×K 298.15 NIST
Cp,solid 201.87 J/mol×K 298.15 NIST
Cp,solid 201.79 J/mol×K 298.15 NIST
ΔfusH 0.02 kJ/mol 354.0 NIST
ΔfusH 22.83 kJ/mol 379.7 NIST
ΔsubH 100.00 ± 10.00 kJ/mol 305.5 NIST
ΔsubH 95.00 ± 4.00 kJ/mol 305.5 NIST
ΔvapH 74.30 ± 0.10 kJ/mol 428.0 NIST
ΔvapH 71.60 ± 0.10 kJ/mol 428.0 NIST
ΔvapH 68.90 ± 0.10 kJ/mol 428.0 NIST
ΔfusS 0.06 J/mol×K 354.0 NIST
ΔfusS 60.12 J/mol×K 379.7 NIST

Similar Compounds

4-Azapyrene. DIBENZ[A,C]ACRIDINE. 1,2-Benzacridine. DIBENZ[A,H]ACRIDINE. Dibenz[a,j]acridine. Naphtho(2,1,8-def)quinoline. 10-Azabenzo[a]pyrene. Benzo[f]quinoline. 5,6-Benzoquinoline hydrochloride. Naphtho(2,1-f)quinoline. 3,4-Benzacridine. .alpha.-Naphthoquinoline. Naphtho(2,3-h)quinoline. 6,7-Benzoquinoline. Benzo[h]quinoline.

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